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D. Ihle

Publications and source records attributed to D. Ihle.

At least 19 recordsLinked to original sources

Superconductivity of strongly correlated electrons on the honeycomb lattice

A microscopic theory of the electronic spectrum and of superconductivity within the t-J model on the honeycomb lattice is developed. We derive the equations for the normal and anomalous Green functions in terms of the Hubbard operators by applying the projection technique. Superconducting pairing of d + id'-type mediated by the antiferromagnetic exchange is found. The superconducting Tc as a function of hole doping exhibits a two-peak structure related to the van Hove singularities of the density of states for the two-band t-J model. At half-filling and for large enough values of the exchange coupling, gapless superconductivity may occur. For small doping the coexistence of antiferromagnetic order and superconductivity is suggested. It is shown that the s-wave pairing is prohibited, since it violates the constraint of no-double-occupancy.

cond-mat.supr-con

Spin excitations and thermodynamics of the t-J model on the honeycomb lattice

We present a spin-rotation-invariant Green-function theory for the dynamic spin susceptibility in the spin-1/2 antiferromagnetic t-J Heisenberg model on the honeycomb lattice. Employing a generalized mean-field approximation for arbitrary temperatures and hole dopings, the electronic spectrum of excitations, the spin-excitation spectrum and thermodynamic quantities (two-spin correlation functions, staggered magnetization, magnetic susceptibility, correlation length) are calculated by solving a coupled system of self-consistency equations for the correlation functions. The temperature and doping dependence of the magnetic (uniform static) susceptibility is ascribed to antiferromagnetic short-range order. Our results on the doping dependencies of the magnetization and susceptibility are analyzed in comparison with previous results for the t_J model on the square lattice.

cond-mat.str-el

Spin excitations and thermodynamics of the antiferromagnetic Heisenberg model on the layered honeycomb lattice

We present a spin-rotation-invariant Green-function theory for the dynamic spin susceptibility in the spin-1/2 antiferromagnetic Heisenberg model on a stacked honeycomb lattice. Employing a generalized mean-field approximation for arbitrary temperatures, the thermodynamic quantities (two-spin correlation functions, internal energy, magnetic susceptibility, staggered magnetization, N'eel temperature, correlation length) and the spin-excitation spectrum are calculated by solving a coupled system of self-consistency equations for the correlation functions. The temperature dependence of the magnetic (uniform static) susceptibility is ascribed to antiferromagnetic short-range order. The Néel temperature is calculated for arbitrary interlayer couplings. Our results are in a good agreement with numerical computations for finite clusters and with available experimental data on the β-Cu2V2O2 compound.

cond-mat.str-el

Thermodynamics of frustrated ferromagnetic spin-$1/2$ Heisenberg chains: The role of inter-chain coupling

The thermodynamics of coupled frustrated ferromagnetic chains is studied within a spin-rotation-invariant Green's function approach. We consider an isotropic Heisenberg spin-half system with a ferromagnetic in-chain coupling $J_1<0$ between nearest neighbors and a frustrating antiferromagnetic next-nearest neighbor in-chain coupling $J_2>0$. We focus on moderate strength of frustration $J_2 < |J_1|/4$ such that the in-chain spin-spin correlations are predominantly ferromagnetic. We consider two inter-chain couplings (ICs) $J_{\perp,y}$ and $J_{\perp,z}$, corresponding to the two axis perpendicular to the chain, where ferromagnetic as well as antiferromagnetic ICs are taken into account. We discuss the influence of frustration on the ground-state properties for antiferromagnetic ICs, where the ground state is of quantum nature. The major part of our study is devoted to the finite-temperature properties. We calculate the critical temperature $T_{c}$ as a function of the competing exchange couplings $J_{2},J_{\perp,y}, J_{\perp,z}$. We find that for fixed ICs $T_c$ monotonically decreases with increasing frustration $J_2$, where as $J_2 \to |J_1|/4$ the $T_c(J_2)$-curve drops down rapidly. To characterize the magnetic ordering below and above $T_c$ we calculate the spin-spin correlation functions $\langle {\bf S}_0 {\bf S}_{\bf R} \rangle$, the magnetic order parameter $M$, the uniform static susceptibility $χ_0$ as well as the correlation length $ξ$. Moreover, we discuss the specific heat $C_V$ and the temperature dependence of the excitation spectrum $ω_{\mathbf{q}}$. As $J_2 \to |J_1|/4$ some unusual frustration-induced features were found, such as an increase of the in-chain spin stiffness (in case of ferromagnetic ICs) or of the in-chain spin-wave velocity (in case of antiferromagnetic ICs) with growing temperature.

cond-mat.str-el

Magnetic order and spin excitations in the Kitaev--Heisenberg model on the honeycomb lattice

We consider the quasi-two-dimensional pseudo-spin-1/2 Kitaev - Heisenberg model proposed for A2IrO3 (A=Li, Na) compounds. The spin-wave excitation spectrum, the sublattice magnetization, and the transition temperatures are calculated in the random phase approximation (RPA) for four different ordered phases, observed in the parameter space of the model: antiferomagnetic, stripe, ferromagnetic, and zigzag phases. The Néel temperature and temperature dependence of the sublattice magnetization are compared with the experimental data on Na2IrO3.

cond-mat.str-el

Thermodynamics of the frustrated $J_1$-$J_2$ Heisenberg ferromagnet on the body-centered cubic lattice with arbitrary spin

We use the spin-rotation-invariant Green's function method as well as the high-temperature expansion to discuss the thermodynamic properties of the frustrated spin-$S$ $J_{1}$-$J_{2}$ Heisenberg magnet on the body-centered cubic lattice. We consider ferromagnetic nearest-neighbor bonds $J_1 < 0$ and antiferromagnetic next-nearest-neighbor bonds $J_2 \ge 0$ and arbitrary spin $S$. We find that the transition point $J_2^c$ between the ferromagnetic ground state and the antiferromagnetic one is nearly independent of the spin $S$, i.e., it is very close to the classical transition point $J_2^{c,{\rm clas}}= \frac{2}{3}|J_1|$. At finite temperatures we focus on the parameter regime $J_2<J_2^c$ with a ferromagnetic ground-state. We calculate the Curie temperature $T_{C}(S,J_{2})$ and derive an empirical formula describing the influence of the frustration parameter $J_{2}$ and spin $S$ on $T_C$. We find that the Curie temperature monotonically decreases with increasing frustration $J_2$, where very close to $J_2^{c,{\rm clas}}$ the $T_C(J_2)$-curve exhibits a fast decay which is well described by a logarithmic term $1/\textrm{log}(\frac{2}{3}|J_1|-J_{2})$. To characterize the magnetic ordering below and above $T_C$, we calculate the spin-spin correlation functions $\langle {\bf S}_{\bf 0} {\bf S}_{\bf R} \rangle$, the spontaneous magnetization, the uniform static susceptibility $χ_0$ as well as the correlation length $ξ$. Moreover, we discuss the specific heat $C_V$ and the temperature dependence of the excitation spectrum. As approaching the transition point $J_2^c$ some unusual features were found, such as negative spin-spin correlations at temperatures above $T_C$ even though the ground state is ferromagnetic or an increase of the spin stiffness with growing temperature.

cond-mat.stat-mech

Magnetic order in the two-dimensional compass-Heisenberg model

A Green-function theory for the dynamic spin susceptibility in the square-lattice spin-1/2 antiferromagnetic compass-Heisenberg model employing a generalized mean-field approximation is presented. The theory describes magnetic long-range order (LRO) and short-range order (SRO) at arbitrary temperatures. The magnetization, N'eel temperature T_N, specific heat, and uniform static spin susceptibility $χ$ are calculated self-consistently. As the main result, we obtain LRO at finite temperatures in two dimensions, where the dependence of T_N on the compass-model interaction is studied. We find that T_N is close to the experimental value for Ba2IrO4. The effects of SRO are discussed in relation to the temperature dependence of $χ$.

cond-mat.str-el

Magnetic order and spin excitations in layered Heisenberg antiferromagnets with compass-model anisotropies

The spin-wave excitation spectrum, the magnetization, and the Néel temperature for the quasi-two-dimensional spin-1/2 antiferromagnetic Heisenberg model with compass-model interaction in the plane proposed for iridates are calculated in the random phase approximation. The spin-wave spectrum agrees well with data of Lanczos diagonalization. We find that the Neel temperature is enhanced by the compass-model interaction and is close to the experimental value for Ba2IrO4.

cond-mat.str-el

Thermodynamics of the two-dimensional frustrated J1-J2 Heisenberg ferromagnet in the collinear stripe regime: Susceptibility and correlation length

We calculate the temperature dependence of the correlation length xi and the uniform susceptibility chi_0 of the frustrated J1-J2 square-lattice Heisenberg ferromagnet in the collinear stripe phase using Green-function technique. The height chi_{max} and the position T(chi_{max}) of the maximum in the chi_0(T) curve exhibit a characteristic dependence on the frustration parameter J2/|J1|, which is well described by power laws, chi_{max}=a(J2-J2^c)^{-nu} and T(chi_{max})=b(J_2-J_2^c), where J2^c = 0.4 and nu is of the order of unity.The correlation length diverges at low temperatures as xi \propto e^{A/T}, where A increases with growing J2/|J1|. We also compare our results with recent measurements on layered vanadium phosphates and find reasonable agreement.

cond-mat.str-el

Optical and dc conductivities of cuprates: Spin-fluctuation scattering in the t-J model

A microscopic theory of the electrical conductivity $σ(ω)$ within the t-J model is developed. An exact representation for $σ(ω)$ is obtained using the memory-function technique for the relaxation function in terms of the Hubbard operators, and the generalized Drude law is derived. The relaxation rate due to the decay of charge excitations into particle-hole pairs assisted by antiferromagnetic spin fluctuations is calculated in the mode-coupling approximation. Using results for the spectral function of spin excitations calculated previously, the relaxation rate and the optical and dc conductivities are calculated in a broad region of doping and temperatures. The reasonable agreement of the theory with experimental data for cuprates proves the important role of spin-fluctuation scattering in the charge dynamics.

cond-mat.str-el

Electron-hole pair condensation at the semimetal-semiconductor transition: a BCS-BEC crossover scenario

We act on the suggestion that an excitonic insulator state might separate---at very low temperatures---a semimetal from a semiconductor and ask for the nature of these transitions. Based on the analysis of electron-hole pairing in the extended Falicov-Kimball model, we show that tuning the Coulomb attraction between both species, a continuous crossover between a BCS-like transition of Cooper-type pairs and a Bose-Einstein condensation of preformed tightly-bound excitons might be achieved in a solid-state system. The precursor of this crossover in the normal state might cause the transport anomalies observed in several strongly correlated mixed-valence compounds.

cond-mat.str-el

Thermodynamics of the frustrated one-dimensional spin-1/2 Heisenberg ferromagnet in a magnetic field

We calculate the low-temperature thermodynamic quantities (magnetization, correlation functions, transverse and longitudinal correlation lengths, spin susceptibility, and specific heat) of the frustrated one-dimensional spin-half J1-J2 Heisenberg ferromagnet, i.e. for J2< 0.25|J1|, in an external magnetic field using a second-order Green-function formalism and full diagonalization of finite systems. We determine power-law relations for the field dependence of the position and the height of the maximum of the uniform susceptibility. Considering the specific heat at low magnetic fields, two maxima in its temperature dependence are found.

cond-mat.str-el

Slave-boson field fluctuation approach to the extended Falicov-Kimball model: charge, orbital, and excitonic susceptibilities

Based on the SO(2)-invariant slave-boson scheme, the static charge, orbital, and excitonic susceptibilities in the extended Falicov-Kimball model are calculated. Analyzing the phase without long-range order we find instabilities towards charge order, orbital order, and the excitonic insulator (EI) phase. The instability towards the EI is in agreement with the saddle-point phase diagram. We also evaluate the dynamic excitonic susceptibility, which allows the investigation of uncondensed excitons. We find qualitatively different features of the exciton dispersion at the semimetal-EI and at the semiconductor-EI transition supporting a crossover scenario between a BCS-type electron-hole condensation and a Bose-Einstein condensation of preformed bound electron-hole pairs.

cond-mat.str-el

Thermodynamics of the one-dimensional frustrated Heisenberg ferromagnet with arbitrary spin

The thermodynamic quantities (spin-spin correlation functions <{\bf S}_0{\bf S}_n>, correlation length ξ, spin susceptibility χ, and specific heat C_V) of the frustrated one-dimensional J1-J2 Heisenberg ferromagnet with arbitrary spin quantum number S below the quantum critical point, i.e. for J2< |J1|/4, are calculated using a rotation-invariant Green-function formalism and full diagonalization as well as a finite-temperature Lanczos technique for finite chains of up to N=18 sites. The low-temperature behavior of the susceptibility χ and the correlation length ξ is well described by χ= (2/3)S^4 (|J1|-4J2) T^{-2} + A S^{5/2} (|J1|-4J2)^{1/2} T^{-3/2} and ξ= S^2 (|J1|-4J2) T^{-1} + B S^{1/2} (|J1|-4J2)^{1/2} T^{-1/2} with A \approx 1.1 ... 1.2 and B \approx 0.84 ... 0.89. The vanishing of the factors in front of the temperature at J2=|J1|/4 indicates a change of the critical behavior of χ and ξ at T \to 0. The specific heat may exhibit an additional frustration-induced low-temperature maximum when approaching the quantum critical point. This maximum appears for S=1/2 and S=1, but was not found for S>1.

cond-mat.str-el

Dynamic spin susceptibility of superconducting cuprates: A microscopic theory of the magnetic resonance mode

A microscopic theory of the dynamic spin susceptibility (DSS) in the superconducting state within the t-J model is presented. It is based on an exact representation for the DSS obtained by applying the Mori-type projection technique for the relaxation function in terms of Hubbard operators. The static spin susceptibility is evaluated by a sum-rule-conserving generalized mean-field approximation, while the self-energy is calculated in the mode-coupling approximation. The spectrum of spin excitations is studied in the underdoped and optimally doped regions. The DSS reveals a resonance mode (RM) at the antiferromagnetic wave vector Q = π(1,1) at low temperatures due to a strong suppression of the damping of spin excitations. This is explained by an involvement of spin excitations in the decay process besides the particle-hole continuum usually considered in random-phase-type approximations. The spin gap in the spin-excitation spectrum at Q plays a dominant role in limiting the decay in comparison with the superconducting gap which results in the observation of the RM even above $T_c$ in the underdoped region. A good agreement with inelastic neutron-scattering experiments on the RM in YBCO compounds is found.

cond-mat.str-el

Thermodynamics of a two-dimensional frustrated spin-1/2 Heisenberg ferromagnet

Using the spin-rotation-invariant Green's function method we calculate the thermodynamic quantities (correlation functions , uniform static spin susceptibility χ, correlation length ξ, and specific heat C_V) of the two-dimensional spin-1/2 J1-J2 Heisenberg ferromagnet for J2 < J2^c \approx 0.44|J1|, where J2^c is the critical frustrating antiferromagnetic next-nearest neighbor coupling at which the ferromagnetic ground state gives way for a ground-state phase with zero magnetization. Examining the low-temperature behavior of χand ξ, in the limit T \to 0 both quantities diverge exponentially, i.e., χ\propto \exp(b/T) and ξ\propto\exp(b/2T), respectively. We find a linear decrease of the coefficient b with increasing frustration according to b=-(π/2)(J1+2J2), i.e., the exponential divergence of χand ξis present up to J2^c. Furthermore, we find an additional low-temperature maximum in the specific heat when approaching the critical point, J2 \to J2^c.

cond-mat.str-el

On the existence of the excitonic insulator phase in the extended Falicov-Kimball model: an SO(2)-invariant slave-boson approach

We re-examine the three-dimensional spinless Falicov-Kimball model with dispersive $f$ electrons at half-filling, addressing the dispute about the formation of an excitonic condensate, which is closely related to the problem of electronic ferroelectricity. To this end, we work out a slave-boson functional integral representation of the suchlike extended Falicov-Kimball model that preserves the $SO(2)\otimes U(1)^{\otimes 2}$ invariance of the action. We find a spontaneous pairing of $c$ electrons with $f$ holes, building an excitonic insulator state at low temperatures, also for the case of initially non-degenerate orbitals. This is in contrast to recent predictions of scalar slave-boson mean-field theory but corroborates previous Hartree-Fock and RPA results. Our more precise treatment of correlation effects, however, leads to a substantial reduction of the critical temperature. The different behavior of the partial densities of states in the weak and strong inter-orbital Coulomb interaction regimes supports a BCS-BEC transition scenario.

cond-mat.str-el

Dynamic spin susceptibility in the t-J model

A relaxation-function theory for the dynamic spin susceptibility in the $t$--$J$ model is presented. By a sum-rule-conserving generalized mean-field approximation (GMFA), the two-spin correlation functions of arbitrary range, the staggered magnetization, the uniform static susceptibility, and the antiferromagnetic correlation length are calculated in a wide region of hole doping and temperaturs. A good agreement with available exact diagonalization (ED) data is found. The correlation length is in reasonable agreement with neutron-scattering experiments on La_{2-δ}Sr_δ)CuO_4. Going beyond the GMFA, the self-energy is calculated in the mode-coupling approximation. The spin dynamics at arbitrary frequencies and wave vectors is studied for various temperatures and hole doping. At low doping a spin-wave-type behavior is found as in the Heisenberg model, while at higher doping a strong damping caused by hole hopping occurs, and a relaxation-type spin dynamics is observed in agreement with the ED results. The local spin susceptibility and its (ω/T) scaling behavior are calculated in a reasonable agreement with experimental and ED data.

cond-mat.str-el